N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[(1R)-1-(benzofuran-2-yl)ethyl]-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[(1R)-1-(2-benzofuranyl)ethyl]-2-[4-(2-ethoxyphenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-[(1R)-1-(benzofuran-2-yl)ethyl]-2-(4-o-phenetylpiperazin-1-ium-1-yl)acetamide Formula: C24H30N3O3+ MolecularWeight: 408.5133

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)NC(C)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)N[C@H](C)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C24H29N3O3/c1-3-29-22-11-7-5-9-20(22)27-14-12-26(13-15-27)17-24(28)25-18(2)23-16-19-8-4-6-10-21(19)30-23/h4-11,16,18H,3,12-15,17H2,1-2H3,(H,25,28)/p+1/t18-/m1/s1